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{
"id": "jvasp-106888",
"created_at": "2022-09-04T14:36:41.320823Z",
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"structure_string": "Li2 Mn1 F4\n1.0\n3.230721 0.004347 8.115350\n1.559517 2.829397 8.115350\n0.007349 0.004347 8.734782\nLi Mn F\n2 1 4\ndirect\n0.204122 0.204123 0.204122 Li\n0.795878 0.795880 0.795876 Li\n0.000000 0.000000 0.000000 Mn\n0.125928 0.125928 0.125928 F\n0.628703 0.628705 0.628702 F\n0.371296 0.371298 0.371296 F\n0.874072 0.874075 0.874070 F\n",
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{
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"structure_string": "Fe8 O6 F10\n1.0\n0.000000 6.049648 -0.020510\n4.729136 0.000000 0.000000\n0.000000 -2.964172 -9.526152\nFe O F\n8 6 10\ndirect\n0.303934 0.449488 0.356868 Fe\n0.068716 0.504830 0.871973 Fe\n0.564067 0.531499 0.891512 Fe\n0.828338 0.512557 0.397787 Fe\n0.435933 0.031499 0.108487 Fe\n0.171663 0.012557 0.602213 Fe\n0.931284 0.004829 0.128027 Fe\n0.696066 0.949489 0.643132 Fe\n0.241773 0.187788 0.207242 O\n0.115718 0.298572 0.464870 O\n0.367053 0.315481 0.970123 O\n0.632947 0.815482 0.029877 O\n0.884283 0.798573 0.535129 O\n0.758228 0.687788 0.792758 O\n0.740253 0.218643 0.232904 F\n0.389655 0.786424 0.520222 F\n0.136162 0.789714 0.025737 F\n0.516513 0.700361 0.276168 F\n0.013377 0.704646 0.275666 F\n0.259747 0.718643 0.767096 F\n0.863839 0.289714 0.974263 F\n0.610346 0.286424 0.479778 F\n0.986624 0.204645 0.724333 F\n0.483488 0.200361 0.723832 F\n",
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{
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"created_at": "2022-09-04T14:38:10.883176Z",
"updated_at": "2022-09-04T14:38:10.883198Z",
"structure_string": "Ti4 Zn4 O8\n1.0\n2.901239 -0.027463 0.014376\n0.680348 7.540904 0.014090\n1.297477 1.044626 8.314497\nTi Zn O\n4 4 8\ndirect\n0.515509 0.291782 0.587518 Ti\n0.106520 0.433950 0.252404 Ti\n0.889526 0.545965 0.775800 Ti\n0.480537 0.688136 0.440684 Ti\n0.498595 0.062671 0.296644 Zn\n0.497429 0.917247 0.731557 Zn\n0.318766 0.842122 0.067031 Zn\n0.677242 0.137793 0.961171 Zn\n0.901080 0.741660 0.597835 O\n0.410770 0.361314 0.815754 O\n0.585272 0.618603 0.212449 O\n0.094966 0.238261 0.430370 O\n-0.017074 0.102710 0.713997 O\n0.686482 0.289853 0.152040 O\n0.013111 0.877208 0.314205 O\n0.309559 0.690062 0.876166 O\n",
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"spacegroup": 2
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{
"id": "jvasp-8435",
"created_at": "2022-09-04T14:37:08.814518Z",
"updated_at": "2022-09-04T14:37:08.814547Z",
"structure_string": "Co3 Sn1 C1\n1.0\n3.844916 -0.000000 -0.000000\n0.000000 3.844916 -0.000000\n0.000000 0.000000 3.844916\nCo Sn C\n3 1 1\ndirect\n0.000000 0.500001 0.500001 Co\n0.500001 0.500001 0.000000 Co\n0.500001 0.000000 0.500001 Co\n0.000000 0.000000 0.000000 Sn\n0.500001 0.500001 0.500001 C\n",
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},
{
"id": "jvasp-9666",
"created_at": "2022-09-04T14:37:50.332455Z",
"updated_at": "2022-09-04T14:37:50.332465Z",
"structure_string": "Ti4 Zn4 O8\n1.0\n2.896350 0.159485 -0.004940\n-1.021061 7.500881 -0.126574\n-1.507202 -1.015844 8.328503\nTi Zn O\n4 4 8\ndirect\n0.102832 0.708234 0.587557 Ti\n0.358599 0.565968 0.252425 Ti\n0.665478 0.454117 0.775777 Ti\n0.921290 0.311842 0.440651 Ti\n0.795720 0.937213 0.296888 Zn\n0.228276 0.082864 0.731294 Zn\n0.383632 0.157744 0.066999 Zn\n0.640215 0.862359 0.961204 Zn\n0.499183 0.258383 0.597803 O\n0.226625 0.638821 0.815778 O\n0.797471 0.381262 0.212428 O\n0.524946 0.761685 0.430406 O\n0.696351 0.897395 0.713941 O\n0.837994 0.710119 0.152148 O\n0.327689 0.122681 0.314263 O\n0.186097 0.309975 0.876054 O\n",
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{
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"created_at": "2022-09-04T14:38:33.239248Z",
"updated_at": "2022-09-04T14:38:33.239273Z",
"structure_string": "K2 Li14 Pb3 O14\n1.0\n6.547872 -0.000000 -3.156526\n-1.829061 6.785737 -3.794189\n0.024837 0.015224 8.421211\nK Li Pb O\n2 14 3 14\ndirect\n0.242375 0.500000 -0.000000 K\n0.757625 0.500000 -0.000000 K\n0.139370 0.709549 0.733094 Li\n0.860630 0.976456 0.266906 Li\n0.593724 0.023544 0.733093 Li\n0.500000 0.841347 -0.000000 Li\n0.500000 0.158653 -0.000000 Li\n0.769607 0.414319 0.539213 Li\n0.230393 0.585680 0.460787 Li\n0.230393 0.875106 0.460787 Li\n0.769607 0.124894 0.539213 Li\n0.593724 0.709549 0.733093 Li\n0.860630 0.290451 0.266906 Li\n0.406276 0.976456 0.266906 Li\n0.139370 0.023544 0.733094 Li\n0.406276 0.290451 0.266906 Li\n0.727144 0.727144 0.454288 Pb\n0.000000 0.000000 0.000000 Pb\n0.272857 0.272856 0.545712 Pb\n0.045367 0.751521 0.503042 O\n0.542325 0.248479 0.496958 O\n0.954633 0.248479 0.496957 O\n0.457675 0.751521 0.503042 O\n0.702404 0.000000 -0.000000 O\n0.297596 0.000000 -0.000000 O\n0.873357 0.682234 0.746713 O\n0.126643 0.317766 0.253286 O\n0.126644 0.935521 0.253287 O\n0.873357 0.064480 0.746713 O\n0.626042 0.408908 0.252084 O\n0.373959 0.591092 0.747915 O\n0.373958 0.156823 0.747915 O\n0.626042 0.843177 0.252084 O\n",
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"density_atomic": 0.08796000415273676,
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"formula_full": "K2 Li14 Pb3 O14",
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{
"id": "jvasp-112421",
"created_at": "2022-09-04T14:38:40.093507Z",
"updated_at": "2022-09-04T14:38:40.093526Z",
"structure_string": "Fe4 P2 O10\n1.0\n5.005792 -0.012767 -1.996414\n0.808546 4.940165 1.996387\n0.023086 -0.027125 7.330941\nFe P O\n4 2 10\ndirect\n0.499994 -0.000004 0.500008 Fe\n0.000003 -0.000005 0.500005 Fe\n0.499997 0.000003 -0.000007 Fe\n0.500005 0.499998 0.000003 Fe\n0.875043 0.375042 0.749999 P\n0.124960 0.624960 0.249999 P\n0.624946 0.124947 0.250003 O\n0.375047 0.875048 0.750002 O\n0.806576 0.205110 0.613162 O\n0.705120 0.306573 0.886847 O\n0.181852 0.306690 0.886625 O\n0.193417 0.794891 0.386838 O\n0.806679 0.681845 0.613367 O\n0.818155 0.693323 0.113359 O\n0.294904 0.693418 0.113169 O\n0.193310 0.318155 0.386630 O\n",
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{
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"created_at": "2022-09-04T14:38:17.219300Z",
"updated_at": "2022-09-04T14:38:17.219321Z",
"structure_string": "Ti2 Zn2 F8\n1.0\n-5.146193 -0.000058 -0.000790\n-0.000117 -5.146594 -0.014789\n2.569037 2.554125 5.158957\nTi Zn F\n2 2 8\ndirect\n0.002041 0.499647 -0.001730 Ti\n0.502033 -0.000347 -0.001728 Ti\n0.752303 0.749808 0.498243 Zn\n0.251749 0.249410 0.498238 Zn\n0.665526 0.663208 0.753582 F\n0.909831 0.907376 0.243168 F\n0.338659 0.336200 0.243002 F\n0.409832 0.836277 0.243106 F\n0.094195 0.091846 0.753398 F\n0.165450 0.591879 0.753500 F\n0.594216 0.163170 0.753533 F\n0.838742 0.407348 0.243101 F\n",
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{
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"created_at": "2022-09-04T14:37:11.005611Z",
"updated_at": "2022-09-04T14:37:11.005642Z",
"structure_string": "Li2 Ti2 P2 O8 F2\n1.0\n5.195155 -0.010697 -0.004141\n-0.740733 5.348901 -0.008787\n-2.371341 -2.427678 6.554340\nLi Ti P O F\n2 2 2 8 2\ndirect\n0.261350 0.613264 0.182736 Li\n0.738649 0.386735 0.817264 Li\n0.000000 0.000000 0.000000 Ti\n0.000000 -0.000000 0.500000 Ti\n0.319811 0.633668 0.765733 P\n0.680189 0.366331 0.234266 P\n0.370767 0.237941 0.082398 O\n0.681503 0.660515 0.335349 O\n0.318497 0.339484 0.664650 O\n0.763140 0.225592 0.389510 O\n0.629232 0.762057 0.917601 O\n0.236860 0.774406 0.610489 O\n0.874010 0.348287 0.109586 O\n0.125989 0.651712 0.890414 O\n0.139500 0.928516 0.267785 F\n0.860499 0.071483 0.732215 F\n",
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{
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"structure_string": "Be2 V1 Pt1\n1.0\n2.739853 0.000000 -0.000000\n0.000000 2.739853 0.000000\n-0.000000 -0.000000 6.058487\nBe V Pt\n2 1 1\ndirect\n0.000000 0.000000 0.765928 Be\n0.000000 0.000000 0.234072 Be\n0.500000 0.500000 0.500000 V\n0.500000 0.500000 0.000000 Pt\n",
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{
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"created_at": "2022-09-04T14:38:03.885474Z",
"updated_at": "2022-09-04T14:38:03.885493Z",
"structure_string": "Cr2 Ni2 O8\n1.0\n4.906643 0.033402 -0.000000\n-1.853277 4.543306 0.000000\n0.000000 0.000000 6.103776\nCr Ni O\n2 2 8\ndirect\n0.641224 0.358775 0.250000 Cr\n0.358775 0.641225 0.750000 Cr\n0.000000 0.000000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.220251 0.263814 0.750000 O\n0.779748 0.736186 0.250000 O\n0.263814 0.220251 0.250000 O\n0.736185 0.779749 0.750000 O\n0.239334 0.760667 0.966853 O\n0.760665 0.239334 0.466853 O\n0.760665 0.239334 0.033147 O\n0.239334 0.760667 0.533148 O\n",
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}
]
}